2-(4-cyanophenoxy)ethyl 1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxylate

Systemtic Name: 2-(4-cyanophenoxy)ethyl 1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxylate Openeye Name: 2-(4-cyanophenoxy)ethyl 1-(4-fluorophenyl)-5-(2-thienyl)-1,2,4-triazole-3-carboxylate CAS Name: 1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxylic acid 2-(4-cyanophenoxy)ethyl ester IUPAC Name: 2-(4-cyanophenoxy)ethyl 1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-5-(2-thienyl)-1,2,4-triazole-3-carboxylic acid 2-(4-cyanophenoxy)ethyl ester Formula: C22H15FN4O3S MolecularWeight: 434.442903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=NN2C3=CC=C(C=C3)F)C(=O)OCCOC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CSC(=C1)C2=NC(=NN2C3=CC=C(C=C3)F)C(=O)OCCOC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H15FN4O3S/c23-16-5-7-17(8-6-16)27-21(19-2-1-13-31-19)25-20(26-27)22(28)30-12-11-29-18-9-3-15(14-24)4-10-18/h1-10,13H,11-12H2